lmpk12050119

Properties Image MNX_ID MNXM28879 reference chebi:230619 formula C20H20O7 global charge 0 mol weight 372.373 InChIKey PQBJXCFVHIZLIF-UHFFFAOYSA-N InChI InChI=1S/C20H20O7/c1-22-14-7-6-11(19(25-4)20(14)26-5)13-10-27-15-9-17(24-3)16(23-2)8-12(15)18(13)21/h6-10H,1-5H3 SMILES COC1=CC2=C(C=C1OC)C(=O)C(C1=C(OC)C(OC)=C(OC)C=C1)=CO2 MNX internals InChI (mnx) InChI=1/C20H20O7/c1-22-14-7-6-11(19(25-4)20(14)26-5)13-10-27-15-9-17(24-3)16(23-2)8-12(15)18(13)21/h6-10H,1-5H3 SMILES (mnx) [CH3:1][O:22][C:14]1=[C:20]([O:26][CH3:5])[C:19]([O:25][CH3:4])=[C:11]([C:13]2=[CH:10][O:27][C:15]3=[CH:9][C:17]([O:24][CH3:3])=[C:16]([O:23][CH3:2])[CH:8]=[C:12]3[C:18]2=[O:21])[CH:6]=[CH:7]1

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0